Vitas-M small molecule compound
(2E)-3-{3-ethoxy-5-iodo-4-[(3-methylbenzyl)oxy]phenyl}prop-2-enoic acid
Catalog ID
STL508139
SMILES CCOc1cc(/C=C/C(=O)O)cc(c1OCc1cccc(c1)C)I
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C19H19IO4 MW 438.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19IO4/c1-3-23-17-11-14(7-8-18(21)22)10-16(20)19(17)24-12-15-6-4-5-13(2)9-15/h4-11H,3,12H2,1-2H3,(H,21,22)/b8-7+InChIKey
CCIZNNYATXAVRF-BQYQJAHWSA-NSynonyms
(~(E))3(3ethoxy5iodo4((3methylphenyl)methoxy)phenyl)prop2enoicacid
(2E)3(3ethoxy5iodo4((3methylbenzyl)oxy)phenyl)prop2enoicacid
132452396
InChI=1SC19H19IO4c1323171114(7818(21)22)1016(20)19(17)24121564513(2)915h411H312H212H3(H2122)b87+
MFCD31615274
ZINC001083102818
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